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Physical Review A

Non-Hamiltonian dynamics and trajectory methods in quantum phase spaces

Jérôme Daligault

Published Jul 11, 2003• 15 citations
Publisher

Abstract

A Lagrangian, moving-with-the-fluid, picture in the quantum Wigner phase space is rigorously defined, introducing a state-dependent current in phase space. Contrary to its classical counterpart, the Lagrangian dynamics in quantum phase space is non-Hamiltonian and elementary phase-space volumes are not conserved. The consequences for the numerical implementation of a fluid trajectory method in quantum phase space are discussed.

DOI
10.1103/physreva.68.010501

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•Aug 14, 2012•0 citations
A Lagrangian, moving-with-the-fluid, picture in the quantum Wigner phase space is rigorously defined, introducing a state-dependent current in phase space. Contrary to its classical counterpart, the Lagrangian dynamics in quantum phase space is non-Hamiltonian and elementary phase-space volumes are not conserved. The consequences for the numerical implementation of a fluid trajectory method in quantum phase space are discussed.
We consider quantum phase-space dynamics using Wigner's representation of quantum mechanics. We stress the usefulness of the integral form for the description of Wigner's phase-space current $\mathbit{J}$ as an alternative to the popular Moyal bracket. The integral form brings out the symmetries between momentum and position representations of quantum mechanics, is numerically stable, and allows us to perform some calculations using elementary integrals instead of Groenewold star products. Our central result is an explicit, elementary proof which shows that only systems up to quadratic in their potential fulfill Liouville's theorem of volume preservation in quantum mechanics. Contrary to a recent suggestion, our proof shows that the non-Liouvillian character of quantum phase-space dynamics cannot be transformed away.
Phase space is the unity of position and momentum configuration space. It allows for an effective description of dynamical systems and is particularly useful when it comes to studying chaos theory and statistical mechanics. After the advent of quantum physics early in the 20th century, E. Wigner [91], J. E. Moyal [62] and H. J. Groenewold [31] introduce a quantum theory in phase space. Despite the apparent added complexity of the mathematics involved in this new framework, the underlying classical and quantum equations show many similarities. The probability distribution in classical physics becomes the Wigner distribution, a probability distribution usually featuring negative values. In 2013, O. Steuernagel and D. Kakofengitis, inspired by the work of H. Bauke [7] and E. Wigner [91], identified the quantum analogue of the classical phase space flow: the Wigner current J [83]. This Wigner current allows the visualisation of quantum dynamics through a quantum fluid dynamics perspective in phase space. This thesis is written by collection of five articles. They are prefaced by an introduction into the basics of quantum phase space theory and its link with both classical phase space dynamics and the standard Schrödinger approach, followed by the articles published during this PhD. Article 1 shows the importance of the integral form of the Wigner current. We use it to derive the Ehrenfest’s theorem, as well as to refute some propositions made within the community. Article 2 shows that, using the Wigner current, an Eulerian and Lagrangian point of view do not always give the same results for the quantum case. We demonstrate that the negativities of the Wigner distribution, sign of quantumness of the system, are created by the Wigner velocity field singularities. The Wigner velocity field is the quantum analogue of the classical phase space velocity field. In Article 3, we see that even though Wigner distributions of quantum systems feature spotty structures which saturate on scales ɑZ [97], the construction of a superoscillating Wigner distribution allows one to generate much smaller structures, of the order of ɑZ /α with α a positive constant potentially very large. In Article 4, we introduce the concept of quantum shear suppression in phase space. The Wigner current features an effective quantum “viscosity”, suppressing classical dynamics fine details. This viscosity is the mechanism by which the Zurek scale is enforced dynamically onto the state in phase space. In Article 5, we apply the previous ideas to Kerr-type oscillators. Its Wigner current is derived, and using it we show that its values are conserved on a ring during the time evolution of the Kerr oscillator. The shear suppression is also studied.
Transcending its origin in the debate on the interpretation of quantum theory, the continuous deterministic trajectory has proved a potent tool in computational quantum mechanics (an excellent introduction to numerical trajectory techniques is provided by Wyatt’s text [1]). It is straightforward to develop a method to derive the timedependent Schrödinger equation from a single-valued continuum of spacetime trajectories, and supply a corresponding exact formula for the wavefunction [2].Anatural language for this theory of evolution is offered by the hydrodynamic analogy, in which wave mechanics corresponds to the Eulerian picture (as shown by Madelung [3]) and the trajectory theory to the Lagrangian picture. The Lagrangian model for the quantum fluid may be developed from a variational principle involving a specific interaction potential (the quantum internal potential energy), and the Euler-Lagrange equations imply a nonlinear partial differential equation to calculate the trajectories of the fluid particles as functions of their initial coordinates and the initial wavefunction. The latter supplies two sets of data to the particle model: the initial density (via the amplitude) and the initial velocity (via the phase). The time-dependent wavefunction is then computed via the standard map between the Lagrangian coordinates and the Eulerian fields.
The hydrodynamic analogy for quantum mechanics is developed in a quantum phase-space representation. The key technical step in this development is the formulation of a phase-space flux (or current) density expression. Lagrangian fluid trajectories in phase space are explicitly found as solutions to a set of first-order ordinary differential equations which are formulated without making semiclassical approximation to the quantum dynamics. These fluid trajectories may be used to construct sharp structures in quantum phase space in the same way that one uses classical trajectories in classical mechanics. While these sharp structures do not themselves represent states, their properties ``control'' the dynamics of states in a manner familiar from the theory of first-order flows. The formalism reduces to Liouville dynamics in the classical limit, \ensuremath{\Elzxh}\ensuremath{\rightarrow}0. In addition to several analytic applications to the pure- and mixed-state dynamics, the approach is numerically implemented for tunneling dynamics in a double-well problem. A new picture for quantum tunneling emerges where the tunneling transport occurs when density spirals outward from one well along real-valued fluid trajectories and then into the other well. The tunneling is found to occur through localized portals, or ``flux gates'' in the phase space. We advocate the phase-space hydrodynamic model as a general tool to understand classical quantum correspondence.
Abstract We show that the dynamics of a closed quantum system obeys the Hamilton variational principle. Even though quantum particles lack well-defined trajectories, their evolution in the Husimi representation can be treated as a flow of multidimensional probability fluid in the phase space. By introducing the classical counterpart of the Husimi representation in a close analogy to the Koopman–von Neumann theory, one can largely unify the formulations of classical and quantum dynamics. We prove that the motions of elementary parcels of both classical and quantum Husimi fluid obey the Hamilton variational principle, and the differences between associated action functionals stem from the differences between classical and quantum pure states. The Husimi action functionals are not unique and defined up to the Skodje flux gauge fixing (Skodje et al 1989 Phys. Rev. A 40 2894). We demonstrate that the gauge choice can dramatically alter flux trajectories. Applications of the presented theory for constructing semiclassical approximations and hybrid classical–quantum theories are discussed.
The behaviour of classical mechanical systems is characterised by their phase portraits, the collections of their trajectories. Heisenberg's uncertainty principle precludes the existence of sharply defined trajectories, which is why traditionally only the time evolution of wave functions is studied in quantum dynamics. These studies are quite insensitive to the underlying structure of quantum phase space dynamics. We identify the flow that is the quantum analog of classical particle flow along phase portrait lines. It reveals hidden features of quantum dynamics and extra complexity. Being constrained by conserved flow winding numbers, it also reveals fundamental topological order in quantum dynamics that has so far gone unnoticed.